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5,10-(Iminomethano)-5H-dibenzo(a,d)cyclohepten-12-one, 10,11-dihydro-

HCID 213727
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Basic information

CAS
26963-69-9
Standard SMILES
O=C1NC2c3ccccc3CC1c1ccccc12
InChIKey
KCXUMFSXWJNUBO-UHFFFAOYSA-N
Molecular formula
C16H13NO
Average molar mass
235.28 g/mol
Monoisotopic mass
235.09971404

Names & identifiers

Preferred name
5,10-(Iminomethano)-5H-dibenzo(a,d)cyclohepten-12-one, 10,11-dihydro-
IUPAC
16-azatetracyclo[7.6.2.02,7.010,15]heptadeca-2,4,6,10,12,14-hexaen-17-one

Names & synonyms

BRN 153644110,11-Dihydro-5,10-(iminomethano)-5H-dibenzo(a,d)cyclohepten-12-one26963-69-95,10-(Iminomethano)-5H-dibenzo(a,d)cyclohepten-12-one, 10,11-dihydro-RefChem:298070DTXSID80949741AM-814/4109141310,11-Dihydro-5H-5,10-(azenometheno)dibenzo[a,d][7]annulen-12-ol16-azatetracyclo[7.6.2.0~2,7~.0~10,15~]heptadeca-2,4,6,10,12,14-hexaen-17-one

Database identifiers

CAS
26963-69-9
PubChem CID
213727
DTXSID
DTXSID80949741

Properties

Computed structural properties

XLogP
2.5
Topological polar surface area
29.1 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
1
Rotatable bonds
0
Heavy atoms
18
Formal charge
0
Complexity
353

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